SCHEMBL6115159

SCHEMBL6115159

CC(C)(C)OC(=O)N1CCC(Cc2ccc(Br)c(O)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
GPR119 Q8TDV5 7/20 0.47
STS P08842 2/20 0.45
YAP1 P46937 3/20 0.45
HTR1A P08908 3/20 0.44
CYP2D6 P10635 3/20 0.44
SLC6A4 P31645 3/20 0.44
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11949137 0.87 GPR119 (0.49) KDM4EPKMGPR119
SCHEMBL28947907 0.86 KDM4E (0.47) KDM4EPKMGPR119YAP1
SCHEMBL578839 0.84 FPR2 (0.53) KDM4EPKMGPR119
SCHEMBL6115087 0.84 HTR1A (0.49) HTR1ACYP2D6SLC6A4MGLL
SCHEMBL2544691 0.84 KDM4E (0.47) KDM4EPKMGPR119STS
SCHEMBL9943153 0.83 HTR1A (0.43) KDM4EPKMGPR119YAP1HTR1A
SCHEMBL8773651 0.83 HTR1A (0.43) KDM4EPKMGPR119YAP1HTR1A
SCHEMBL8773592 0.83 SLC6A4 (0.47) KDM4EPKMGPR119HTR1ACYP2D6
SCHEMBL12263494 0.83 KDM4E (0.53) KDM4EPKMGPR119
SCHEMBL1363304 0.82 KDM4E (0.51) KDM4EPKMGPR119STSYAP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778970-B2 Benzyl piperidine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-07-15 US disclosed
US-8778970-B2 Benzyl piperidine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-07-15 US disclosed
US-8778970-B2 Benzyl piperidine compound DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-07-15 US disclosed
EP-2463286-A1 BENZYL PIPERIDINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-06-13 EP disclosed
EP-2463286-A1 BENZYL PIPERIDINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-06-13 EP disclosed
US-20120130077-A1 BENZYL PIPERIDINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 US disclosed
US-20120130077-A1 BENZYL PIPERIDINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 US disclosed
US-20120130077-A1 BENZYL PIPERIDINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120130077-A1 BENZYL PIPERIDINE COMPOUND HTR1D, HTR1A, HTR1B KDM4E 807/4885PKM 1705/4885GPR119 733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.